| CAS Number | 1423025-48-2 |
| Catalog Number | AG01A2ZW |
| Chemical Name | 2-Amino-1-[3-(difluoromethoxy)phenyl]ethan-1-ol |
| IUPAC Name | 2-amino-1-[3-(difluoromethoxy)phenyl]ethanol |
| InChI | InChI=1S/C9H11F2NO2/c10-9(11)14-7-3-1-2-6(4-7)8(13)5-12/h1-4,8-9,13H,5,12H2 |
| InChI Key | NKEMCDXOGFYLCQ-UHFFFAOYSA-N |
| MDL Number | MFCD22628436 |
| Molecular Formula | C9H11F2NO2 |
| Molecular Weight | 203.1859 |
| SMILES | C1=CC(=CC(=C1)OC(F)F)C(CN)O |
| Synonyms | 2-amino-1-[3-(difluoromethoxy)phenyl]ethan-1-ol,
1423025-48-2,
AKOS033399030,
MCULE-9258765753,
NE49044,
Z1526503456,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.189g/mol |
| Monoisotopic Mass | 203.076g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 55.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number